BRD-K79222491 (BRD-K79222491)
Overview
- pert_id
- BRD-K79222491
- Name
- BRD-K79222491
- Collection
- STRD
- MOA
- Unknown
- Target(s)
- Unknown
- Indication(s)
- Unknown
- Phase
- Unknown
- Canonical SMILES
- FC(F)(F)c1ccc2[nH]c(CNc3nc(nc4n(cnc34)-c3ccsc3)N3CCOCC3)nc2c1
- InChI key
- InChIKey=OJYLDJPQAFKURV-UHFFFAOYSA-N
- InChI string
- InChI=1S/C22H19F3N8OS/c23-22(24,25)13-1-2-15-16(9-13)29-17(28-15)10-26-19-18-20(33(12-27-18)14-3-8-35-11-14)31-21(30-19)32-4-6-34-7-5-32/h1-3,8-9,11-12H,4-7,10H2,(H,28,29)(H,26,30,31)
- Molecular formula
- C22H19F3N8OS
- Molecular weight
- 500.499
External links
- PubChem
- 45100452
- SEP-L1000
- BRD-K79222491
Predicted MOAs
| MOA | Probability |
|---|---|
| PI3K inhibitor | 0.3434 |
| CDK inhibitor | 0.3391 |
| Aurora kinase inhibitor | 0.0642 |
| dopamine receptor antagonist | 0.0403 |
| histamine receptor antagonist | 0.0249 |
| mTOR inhibitor | 0.0221 |
| HSP inhibitor | 0.0193 |
| adrenergic receptor antagonist | 0.0158 |
| EGFR inhibitor | 0.0120 |
| HDAC inhibitor | 0.0110 |
Chemical structure
